CID 6957582

N-(3,5-bis(trifluoromethyl)phenyl)-3-phenyl-2-propenamide

Structural Information

Molecular Formula
C17H11F6NO
SMILES
C1=CC=C(C=C1)/C=C/C(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F
InChI
InChI=1S/C17H11F6NO/c18-16(19,20)12-8-13(17(21,22)23)10-14(9-12)24-15(25)7-6-11-4-2-1-3-5-11/h1-10H,(H,24,25)/b7-6+
InChIKey
HAZXGZLAXKZRQX-VOTSOKGWSA-N
Compound name
(E)-N-[3,5-bis(trifluoromethyl)phenyl]-3-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

359.0745 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.08178 177.2
[M+Na]+ 382.06372 185.4
[M-H]- 358.06722 176.2
[M+NH4]+ 377.10832 189.4
[M+K]+ 398.03766 178.8
[M+H-H2O]+ 342.07176 164.7
[M+HCOO]- 404.07270 191.4
[M+CH3COO]- 418.08835 214.1
[M+Na-2H]- 380.04917 179.2
[M]+ 359.07395 168.3
[M]- 359.07505 168.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe